6-ethyl-2-(phenylmethylsulfanyl)-1H-pyrimidin-4-one

Systemtic Name: 6-ethyl-2-(phenylmethylsulfanyl)-1H-pyrimidin-4-one Openeye Name: 2-benzylsulfanyl-6-ethyl-1H-pyrimidin-4-one CAS Name: 6-ethyl-2-(phenylmethylthio)-1H-pyrimidin-4-one IUPAC Name: 2-benzylsulfanyl-6-ethyl-1H-pyrimidin-4-one Traditional Name: 2-(benzylthio)-6-ethyl-1H-pyrimidin-4-one Formula: C13H14N2OS MolecularWeight: 246.32806

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=O)N=C(N1)SCC2=CC=CC=C2

Isomeric SMILES

CCC1=CC(=O)N=C(N1)SCC2=CC=CC=C2

InChI

InChI=1S/C13H14N2OS/c1-2-11-8-12(16)15-13(14-11)17-9-10-6-4-3-5-7-10/h3-8H,2,9H2,1H3,(H,14,15,16)